ethyl 3-[2-pentyl-3-(phenylcarbonyl)pyridin-4-yl]benzoate

Systemtic Name: ethyl 3-[2-pentyl-3-(phenylcarbonyl)pyridin-4-yl]benzoate Openeye Name: ethyl 3-(3-benzoyl-2-pentyl-4-pyridyl)benzoate CAS Name: 3-(3-benzoyl-2-pentyl-4-pyridinyl)benzoic acid ethyl ester IUPAC Name: ethyl 3-(3-benzoyl-2-pentylpyridin-4-yl)benzoate Traditional Name: 3-(2-amyl-3-benzoyl-4-pyridyl)benzoic acid ethyl ester Formula: C26H27NO3 MolecularWeight: 401.49748

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NC=CC(=C1C(=O)C2=CC=CC=C2)C3=CC(=CC=C3)C(=O)OCC

Isomeric SMILES

CCCCCC1=NC=CC(=C1C(=O)C2=CC=CC=C2)C3=CC(=CC=C3)C(=O)OCC

InChI

InChI=1S/C26H27NO3/c1-3-5-7-15-23-24(25(28)19-11-8-6-9-12-19)22(16-17-27-23)20-13-10-14-21(18-20)26(29)30-4-2/h6,8-14,16-18H,3-5,7,15H2,1-2H3